N-[3-cyano-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[3-cyano-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[3-cyano-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[3-cyano-1-(2-methoxyphenyl)-2-pyrrolo[3,2-b]quinoxalinyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[3-cyano-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-cyano-1-(2-methoxyphenyl)pyrrolo[3,2-b]quinoxalin-2-yl]-4-nitro-benzenesulfonamide Formula: C24H16N6O5S MolecularWeight: 500.48604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2C(=C(C3=NC4=CC=CC=C4N=C32)C#N)NS(=O)(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C24H16N6O5S/c1-35-21-9-5-4-8-20(21)29-23(28-36(33,34)16-12-10-15(11-13-16)30(31)32)17(14-25)22-24(29)27-19-7-3-2-6-18(19)26-22/h2-13,28H,1H3